SCHEMBL23309580

SCHEMBL23309580

CC(C)NC(=O)c1cc(F)nc(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 1/20 0.41
▸ ALOX5 P09917 1/20 0.41
▸ RECQL P46063 1/20 0.40
▸ MAOA P21397 2/20 0.39
▸ MAOB P27338 2/20 0.39
▸ GAA P10253 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ AR P10275 1/20 0.37
▸ MLYCD O95822 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ ALPL P05186 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ LMNA P02545 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23309724 0.81 GAA (0.55) GAAALDH1A1NPC1LMNAHPGD
SCHEMBL23309725 0.81 GAA (0.43) KLKB1MAOAMAOBGAAALDH1A1
SCHEMBL23309640 0.80 DHODH (0.39) KLKB1JAK2
SCHEMBL23309619 0.77 NPC1 (0.40) GAAALDH1A1NPSR1TSHRCASP1
SCHEMBL23309542 0.77 CA12 (0.42) ALDH1A1NPC1RAB9ALMNAMAPT
SCHEMBL23309530 0.77 KLKB1 (0.39) KLKB1ALOX15LMNAHPGDJAK2
SCHEMBL23309718 0.77 POLB (0.49) MAOAMAOBGAAALDH1A1AR
SCHEMBL23309632 0.76 KDM4E (0.36) KLKB1ALDH1A1HTTCASP1SMN1; SMN2
SCHEMBL23309675 0.75 MLYCD (0.47) RECQLALDH1A1MLYCDNPSR1ALOX15
SCHEMBL23309730 0.75 KMT2A (0.47) MAOAMAOBGAAALDH1A1HTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210120817-A1 PLANT DISEASE CONTROL AGENT MEIJI SEIKA PHARMA CO., LTD. (JP) 2021-04-29 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210120817-A1 PLANT DISEASE CONTROL AGENT BROX, ALG1, CTRL KLKB1 4243/4885ALOX5 1729/4885RECQL 1446/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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